3-[[1-[2-[(4-methoxy-3-phenylmethoxy-phenyl)carbonylamino]-3-methyl-butanoyl]pyrrolidin-2-yl]carbonylamino]-4-oxidanylidene-butanoic acid

Systemtic Name: 3-[[1-[2-[(4-methoxy-3-phenylmethoxy-phenyl)carbonylamino]-3-methyl-butanoyl]pyrrolidin-2-yl]carbonylamino]-4-oxidanylidene-butanoic acid Openeye Name: 3-[[1-[2-[(3-benzyloxy-4-methoxy-benzoyl)amino]-3-methyl-butanoyl]pyrrolidine-2-carbonyl]amino]-4-oxo-butanoic acid CAS Name: 3-[[[1-[2-[[(4-methoxy-3-phenylmethoxyphenyl)-oxomethyl]amino]-3-methyl-1-oxobutyl]-2-pyrrolidinyl]-oxomethyl]amino]-4-oxobutanoic acid IUPAC Name: 3-[[1-[2-[(4-methoxy-3-phenylmethoxybenzoyl)amino]-3-methylbutanoyl]pyrrolidine-2-carbonyl]amino]-4-oxobutanoic acid Traditional Name: 3-[[1-[2-[(3-benzoxy-4-methoxy-benzoyl)amino]-3-methyl-butanoyl]prolyl]amino]-4-keto-butyric acid Formula: C29H35N3O8 MolecularWeight: 553.6035

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)N1CCCC1C(=O)NC(CC(=O)O)C=O)NC(=O)C2=CC(=C(C=C2)OC)OCC3=CC=CC=C3

Isomeric SMILES

CC(C)C(C(=O)N1CCCC1C(=O)NC(CC(=O)O)C=O)NC(=O)C2=CC(=C(C=C2)OC)OCC3=CC=CC=C3

InChI

InChI=1S/C29H35N3O8/c1-18(2)26(29(38)32-13-7-10-22(32)28(37)30-21(16-33)15-25(34)35)31-27(36)20-11-12-23(39-3)24(14-20)40-17-19-8-5-4-6-9-19/h4-6,8-9,11-12,14,16,18,21-22,26H,7,10,13,15,17H2,1-3H3,(H,30,37)(H,31,36)(H,34,35)